N-(6-ethyl-5-phenyl-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(6-ethyl-5-phenyl-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]ethanamide Openeye Name: N-(6-ethyl-5-phenyl-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide CAS Name: N-(6-ethyl-5-phenyl-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)-1-piperazinyl]acetamide IUPAC Name: N-(6-ethyl-5-phenyl-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide Traditional Name: N-(6-ethyl-5-phenyl-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazino]acetamide Formula: C27H27N5O3S MolecularWeight: 501.59998

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1C3=CC=CC=C3)N=C(S2)NC(=O)CN4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC2=C(C=C1C3=CC=CC=C3)N=C(S2)NC(=O)CN4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H27N5O3S/c1-2-19-16-25-24(17-23(19)20-6-4-3-5-7-20)28-27(36-25)29-26(33)18-30-12-14-31(15-13-30)21-8-10-22(11-9-21)32(34)35/h3-11,16-17H,2,12-15,18H2,1H3,(H,28,29,33)